CID 11138018

Amppt

Structural Information

Molecular Formula

C₆H₁₄NO₄P

SMILES

CC(CCP(=O)(C)O)(C(=O)O)N

InChI

InChI=1S/C6H14NO4P/c1-6(7,5(8)9)3-4-12(2,10)11/h3-4,7H2,1-2H3,(H,8,9)(H,10,11)

InChIKey

BGDOUYCSLAVFRE-UHFFFAOYSA-N

Compound name

2-amino-4-[hydroxy(methyl)phosphoryl]-2-methylbutanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 195.06604 Da
Monoisotopic Mass: -4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	196.07332	143.0
[M+Na]+	218.05526	148.2
[M+NH4]+	213.09986	146.9
[M+K]+	234.02920	147.8
[M-H]-	194.05876	138.0
[M+Na-2H]-	216.04071	142.4
[M]+	195.06549	141.6
[M]-	195.06659	141.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe